2,2-bis(hydroxymethyl)-7-(4-nonylphenoxy)-1,6-bis(oxidanyl)heptan-4-one

Systemtic Name: 2,2-bis(hydroxymethyl)-7-(4-nonylphenoxy)-1,6-bis(oxidanyl)heptan-4-one Openeye Name: 1,6-dihydroxy-2,2-bis(hydroxymethyl)-7-(4-nonylphenoxy)heptan-4-one CAS Name: 1,6-dihydroxy-2,2-bis(hydroxymethyl)-7-(4-nonylphenoxy)-4-heptanone IUPAC Name: 1,6-dihydroxy-2,2-bis(hydroxymethyl)-7-(4-nonylphenoxy)heptan-4-one Traditional Name: 1,6-dihydroxy-2,2-dimethylol-7-(4-nonylphenoxy)heptan-4-one Formula: C24H40O6 MolecularWeight: 424.5708

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC=C(C=C1)OCC(CC(=O)CC(CO)(CO)CO)O

Isomeric SMILES

CCCCCCCCCC1=CC=C(C=C1)OCC(CC(=O)CC(CO)(CO)CO)O

InChI

InChI=1S/C24H40O6/c1-2-3-4-5-6-7-8-9-20-10-12-23(13-11-20)30-16-22(29)14-21(28)15-24(17-25,18-26)19-27/h10-13,22,25-27,29H,2-9,14-19H2,1H3